COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK167070
Chemical Name: (2E)-3-(3,4-dimethoxyphenyl)-N-[(E)-[(6-oxo-4-{[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]methyl}-1,6-dihydropyrimidin-2-yl)amino](phenylamino)methylidene]prop-2-enamide
Smiles: COc1cc(/C=C/C(=O)/N=C(/Nc2nc(CSc3nnnn3c3ccccc3)cc(=O)[nH]2)\Nc2ccccc2)ccc1OC

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Molecular Weight: 609.67
Empirical Formula: C30H27N9O4S

Physical State: Dry powder
Available Amount: 82 mg

Lipinsky:
logP: 5.789
Rotatable bonds: 7
H-donors: 3
H-acceptors: 4
PSA: 182
Number of rings: 5

     

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